smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=CCSc1nnc(N[NH+]=Cc2ccc(N(C)C)cc2)[nH]1	ZINC000005929926	181297233	/nfs/dbraw/zinc/29/72/33/181297233.db2.gz	XFAMBXXUWYUQNM-XNTDXEJSSA-N	1	2	302.407	2.595	30	30		DFECLO
Cc1cc(C)n2c(C[N@@H+](C)Cc3cc(C#N)ccc3F)cnc2n1	ZINC000097032503	185399317	/nfs/dbraw/zinc/39/93/17/185399317.db2.gz	IPDGOGWAGJRKBA-UHFFFAOYSA-N	1	2	323.375	2.989	30	30		DFECLO
Cc1cc(C)n2c(C[N@H+](C)Cc3cc(C#N)ccc3F)cnc2n1	ZINC000097032503	185399318	/nfs/dbraw/zinc/39/93/18/185399318.db2.gz	IPDGOGWAGJRKBA-UHFFFAOYSA-N	1	2	323.375	2.989	30	30		DFECLO
CC(C)Sc1nnc(N[NH+]=Cc2ccc(N(C)C)cc2)[nH]1	ZINC000005911292	181295761	/nfs/dbraw/zinc/29/57/61/181295761.db2.gz	AJNSVUIWZHRVQP-OQLLNIDSSA-N	1	2	304.423	2.817	30	30		DFECLO